2-(pyrrolidin-3-ylmethoxymethyl)quinoline

C15H18N2O — CID 46941556

IUPAC2-(pyrrolidin-3-ylmethoxymethyl)quinoline
SMILESc1ccc2nc(COCC3CCNC3)ccc2c1
InChIInChI=1S/C15H18N2O/c1-2-4-15-13(3-1)5-6-14(17-15)11-18-10-12-7-8-16-9-12/h1-6,12,16H,7-11H2
InChIKeySBLYIGABGGJMTC-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.36
Rot. Bonds4

About 2-(pyrrolidin-3-ylmethoxymethyl)quinoline

2-(pyrrolidin-3-ylmethoxymethyl)quinoline (PubChem CID 46941556) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(pyrrolidin-3-ylmethoxymethyl)quinoline.

Molecular Properties

Compound Name2-(pyrrolidin-3-ylmethoxymethyl)quinoline
PubChem CID46941556
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name2-(pyrrolidin-3-ylmethoxymethyl)quinoline
SMILESc1ccc2nc(COCC3CCNC3)ccc2c1
InChIInChI=1S/C15H18N2O/c1-2-4-15-13(3-1)5-6-14(17-15)11-18-10-12-7-8-16-9-12/h1-6,12,16H,7-11H2
InChIKeySBLYIGABGGJMTC-UHFFFAOYSA-N
XLogP2.36
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(pyrrolidin-3-ylmethoxymethyl)pyrimidine
CID 62698828
(3R)-3-(phenylmethoxymethyl)pyrrolidine
CID 26192483
3-[(2-chlorophenyl)methoxymethyl]pyrrolidine
CID 56829907
(3R)-3-[(2-chlorophenyl)methoxymethyl]pyrrolidine
CID 86320752
3-[(2-methylphenyl)methoxymethyl]pyrrolidine
CID 56829929
1-methyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole
CID 82870045
1-cyclopentyl-3-(pyrrolidin-3-ylmethoxymethyl)pyrazole
CID 64783422
3-methyl-2-(pyrrolidin-3-ylmethoxy)quinoline
CID 63228996
N-methyl-N-(quinolin-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride
CID 119923035
(3S)-3-[(2,6-difluorophenyl)methoxymethyl]pyrrolidine
CID 86321771
3-[(2-methoxyphenyl)methoxymethyl]pyrrolidine
CID 53414657
2-(prop-2-enoxymethyl)quinoline
CID 10821856

Frequently Asked Questions

What is the IUPAC name of 2-(pyrrolidin-3-ylmethoxymethyl)quinoline?
The IUPAC name of 2-(pyrrolidin-3-ylmethoxymethyl)quinoline (CID 46941556) is 2-(pyrrolidin-3-ylmethoxymethyl)quinoline.
What is the SMILES notation for 2-(pyrrolidin-3-ylmethoxymethyl)quinoline?
The canonical SMILES for 2-(pyrrolidin-3-ylmethoxymethyl)quinoline is c1ccc2nc(COCC3CCNC3)ccc2c1.
What is the InChIKey of 2-(pyrrolidin-3-ylmethoxymethyl)quinoline?
The InChIKey is SBLYIGABGGJMTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-2-4-15-13(3-1)5-6-14(17-15)11-18-10-12-7-8-16-9-12/h1-6,12,16H,7-11H2.
What are the key properties of 2-(pyrrolidin-3-ylmethoxymethyl)quinoline?
2-(pyrrolidin-3-ylmethoxymethyl)quinoline has a molecular weight of 242.32 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyrrolidin-3-ylmethoxymethyl)quinoline is sourced from PubChem (CID 46941556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).